P   LATTICE,NONEQUIV.ATOMS   5   60 Pbcn                                       
MODE OF CALC=RELA unit=bohr                                                    
 26.810490 10.771628  9.511181 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.33120000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -1: X=0.00000000 Y=0.66880000 Z=0.75000000
      -1: X=0.50000000 Y=0.83120000 Z=0.25000000
      -1: X=0.50000000 Y=0.16880000 Z=0.75000000
Mg         NPT=  781  R0=.000100000 RMT= 1.95        Z:  12.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.34007000 Y=0.31810000 Z=0.24620000
          MULT= 8          ISPLIT= 8
      -2: X=0.65993000 Y=0.68190000 Z=0.75380000
      -2: X=0.84007000 Y=0.81810000 Z=0.25380000
      -2: X=0.15993000 Y=0.18190000 Z=0.74620000
      -2: X=0.15993000 Y=0.81810000 Z=0.24620000
      -2: X=0.84007000 Y=0.18190000 Z=0.75380000
      -2: X=0.65993000 Y=0.31810000 Z=0.25380000
      -2: X=0.34007000 Y=0.68190000 Z=0.74620000
Nb         NPT=  781  R0=.000010000 RMT= 1.77        Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.09550000 Y=0.10560000 Z=0.06790000
          MULT= 8          ISPLIT= 8
      -3: X=0.90450000 Y=0.89440000 Z=0.93210000
      -3: X=0.59550000 Y=0.60560000 Z=0.43210000
      -3: X=0.40450000 Y=0.39440000 Z=0.56790000
      -3: X=0.40450000 Y=0.60560000 Z=0.06790000
      -3: X=0.59550000 Y=0.39440000 Z=0.93210000
      -3: X=0.90450000 Y=0.10560000 Z=0.43210000
      -3: X=0.09550000 Y=0.89440000 Z=0.56790000
O          NPT=  781  R0=.000100000 RMT= 1.60        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.42040000 Y=0.11630000 Z=0.09230000
          MULT= 8          ISPLIT= 8
      -4: X=0.57960000 Y=0.88370000 Z=0.90770000
      -4: X=0.92040000 Y=0.61630000 Z=0.40770000
      -4: X=0.07960000 Y=0.38370000 Z=0.59230000
      -4: X=0.07960000 Y=0.61630000 Z=0.09230000
      -4: X=0.92040000 Y=0.38370000 Z=0.90770000
      -4: X=0.57960000 Y=0.11630000 Z=0.40770000
      -4: X=0.42040000 Y=0.88370000 Z=0.59230000
O          NPT=  781  R0=.000100000 RMT= 1.60        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.24400000 Y=0.12220000 Z=0.41670000
          MULT= 8          ISPLIT= 8
      -5: X=0.75600000 Y=0.87780000 Z=0.58330000
      -5: X=0.74400000 Y=0.62220000 Z=0.08330000
      -5: X=0.25600000 Y=0.37780000 Z=0.91670000
      -5: X=0.25600000 Y=0.62220000 Z=0.41670000
      -5: X=0.74400000 Y=0.37780000 Z=0.58330000
      -5: X=0.75600000 Y=0.12220000 Z=0.08330000
      -5: X=0.24400000 Y=0.87780000 Z=0.91670000
O          NPT=  781  R0=.000100000 RMT= 1.60        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000